chempirical

7-Bromoquinazoline

C8H5BrN2CAS 89892-22-8209.05 g/mol

Open in Covalent MOL file
NNBr
Aryl halide

Properties

Molecular formula
C8H5BrN2
Molar mass
209.05 g/mol
Exact mass
207.9636 Da
logP
2.39Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
89892-22-8
SMILES
C1=CC2=CN=CN=C2C=C1Br
InChIKey
KMVULHBAEVRKCP-UHFFFAOYSA-N
InChI
InChI=1S/C8H5BrN2/c9-7-2-1-6-4-10-5-11-8(6)3-7/h1-5H

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 7-Bromoquinazoline

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

7-Bromoquinoline4965-36-053 % similar 7-Bromo-2-chloroquinazoline953039-66-253 % similar Quinazoline253-82-750 % similar 6-Bromoisoquinoline34784-05-950 % similar 7-Bromoisoquinoline58794-09-550 % similar 2,6-Dibromonaphthalene13720-06-444 % similar 7-Bromo-4-chloroquinazoline573675-55-544 % similar 2,7-Dibromonaphthalene58556-75-543 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Bromoquinoxaline36856-91-4 6-Bromoquinoxaline50998-17-9 6-Bromo-quinazoline89892-21-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook